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2-Methylene-1,3-bis(phenylmethylene)cyclooctane

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-Methylene-1,3-bis(phenylmethylene)cyclooctane
SpectraBase Compound ID FiLQfnsJpdM
InChI InChI=1S/C23H24/c1-19-22(17-20-11-5-2-6-12-20)15-9-4-10-16-23(19)18-21-13-7-3-8-14-21/h2-3,5-8,11-14,17-18H,1,4,9-10,15-16H2/b22-17+,23-18+
InChIKey VGSZPRQJLWTCKM-SKWBHROBSA-N
Mol Weight 300.44 g/mol
Molecular Formula C23H24
Exact Mass 300.187801 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9MRKON3M54P
Name 2-Methylene-1,3-bis(phenylmethylene)cyclooctane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.187800773 u
Formula C23H24
InChI InChI=1S/C23H24/c1-19-22(17-20-11-5-2-6-12-20)15-9-4-10-16-23(19)18-21-13-7-3-8-14-21/h2-3,5-8,11-14,17-18H,1,4,9-10,15-16H2/b22-17+,23-18+
InChIKey VGSZPRQJLWTCKM-SKWBHROBSA-N
SMILES C1(\C(=C\C=2C=CC=CC2)CCCCC\C1=C\C1=CC=CC=C1)=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91148